2-tert-butyl-1-pentyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium tetrafluoroborate

Systemtic Name: 2-tert-butyl-1-pentyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium tetrafluoroborate Openeye Name: 2-tert-butyl-1-pentyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium tetrafluoroborate CAS Name: 2-tert-butyl-1-pentyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium tetrafluoroborate IUPAC Name: 2-tert-butyl-1-pentyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium tetrafluoroborate Traditional Name: 1-amyl-2-tert-butyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium tetrafluoroborate Formula: C28H34BF4N MolecularWeight: 471.380873

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCCCC[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C(C)(C)C

Isomeric SMILES

[B-](F)(F)(F)F.CCCCC[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C(C)(C)C

InChI

InChI=1S/C28H34N.BF4/c1-5-6-12-19-29-26(28(2,3)4)20-25(21-13-8-7-9-14-21)24-18-17-22-15-10-11-16-23(22)27(24)29;2-1(3,4)5/h7-11,13-16,20H,5-6,12,17-19H2,1-4H3;/q+1;-1